SCHEMBL4743129

SCHEMBL4743129

CC(=O)c1ccc(Oc2ccccc2C(C)=O)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.62
HPGD P15428 1/20 0.62
RAB9A P51151 1/20 0.62
CTNNB1 P35222 1/20 0.51
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
LMNA P02545 3/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
KDM4E B2RXH2 2/20 0.49
ALDH1A1 P00352 2/20 0.49
MAOB P27338 1/20 0.47
PARP10 Q53GL7 1/20 0.46
NPSR1 Q6W5P4 1/20 0.45
GAA P10253 3/20 0.45
POLB P06746 1/20 0.45
CRHBP P24387 1/20 0.45
FNTA P49354 1/20 0.45
FNTB P49356 1/20 0.45
CRHR2 Q13324 1/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9638920 0.93 CTNNB1 (0.58) MAPTHPGDRAB9ACTNNB1MEN1
SCHEMBL2559974 0.90 HPGD (0.58) MAPTHPGDRAB9ACTNNB1MEN1
SCHEMBL6630321 0.88 PARP10 (0.62) MAPTHPGDRAB9ACTNNB1MEN1
SCHEMBL3179214 0.87 CTNNB1 (0.67) MAPTRAB9ACTNNB1MEN1KMT2A
SCHEMBL29679671 0.87 CTNNB1 (0.67) MAPTRAB9ACTNNB1MEN1KMT2A
SCHEMBL1555274 0.87 SMN1; SMN2 (0.55) MAPTHPGDRAB9ACTNNB1MEN1
SCHEMBL11604077 0.86 CTNNB1 (0.51) MAPTHPGDRAB9ACTNNB1MEN1
SCHEMBL19524204 0.86 SCN8A (0.53) MAPTCTNNB1MEN1KMT2ALMNA
Hydrochloric Acid SCHEMBL8136102 0.85 CTNNB1 (0.65) MAPTRAB9ACTNNB1MEN1KMT2A
SCHEMBL2303571 0.84 MAPT (0.60) MAPTHPGDCTNNB1MEN1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008099415-A1 NOVEL SUBSTITUTED BIS-1, 2, 4-TRIOXANES AND A PROCESS FOR PREPARATION THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2008-08-21 WO disclosed